CID 47003283

Methyl 2-(2,5-difluorophenyl)-2-(methylamino)acetate hydrochloride

Structural Information

Molecular Formula
C10H11F2NO2
SMILES
CNC(C1=C(C=CC(=C1)F)F)C(=O)OC
InChI
InChI=1S/C10H11F2NO2/c1-13-9(10(14)15-2)7-5-6(11)3-4-8(7)12/h3-5,9,13H,1-2H3
InChIKey
RYFNDOUCPLCYIA-UHFFFAOYSA-N
Compound name
methyl 2-(2,5-difluorophenyl)-2-(methylamino)acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

215.07579 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.08307 143.1
[M+Na]+ 238.06501 151.0
[M-H]- 214.06851 144.5
[M+NH4]+ 233.10961 161.7
[M+K]+ 254.03895 149.3
[M+H-H2O]+ 198.07305 135.3
[M+HCOO]- 260.07399 164.9
[M+CH3COO]- 274.08964 191.2
[M+Na-2H]- 236.05046 146.0
[M]+ 215.07524 141.9
[M]- 215.07634 141.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.